Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | KCNJ5 | P48544 | 1/20 | 0.33 |
| ▸ | KCNJ3 | P48549 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28906218 | 0.89 | KCNJ5 (0.36) | ALDH1A1MEN1KMT2ALMNADRD2 | |
| SCHEMBL28509585 | 0.89 | ALDH1A1 (0.33) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL24723411 | 0.83 | LPL (0.33) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL586151 | 0.78 | LPL (0.41) | ALDH1A1MEN1KMT2ADRD2DRD3 | |
| SCHEMBL24269630 | 0.77 | ALDH1A1 (0.39) | ALDH1A1MEN1KMT2ATP53MAPT | |
| SCHEMBL18621693 | 0.77 | DRD2 (0.45) | DRD2DRD3OPRM1 | |
| SCHEMBL3665155 | 0.76 | MEN1 (0.42) | ALDH1A1MEN1KMT2ADRD2CYP3A4 | |
| SCHEMBL24722841 | 0.76 | HRH4 (0.35) | DRD2DRD3MAPTKDM4E | |
| SCHEMBL13958134 | 0.75 | DRD2 (0.38) | ALDH1A1MEN1KMT2ADRD2DRD3 | |
| SCHEMBL24722942 | 0.75 | ROCK1 (0.37) | ALDH1A1MEN1KMT2AMAPTKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112243439-A | Pyrrolo [2,3-B ] pyridines or pyrrolo [2,3-B ] pyrazines as HPK1 inhibitors and uses thereof | 百济神州有限公司 | 2021-01-19 | — | — | CN | disclosed |